OTAVA-ZINC05332919 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 55 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6820 -0.4720 -1.1930 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7870 -1.8080 -1.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3220 -2.5600 -0.5180 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4590 -2.3510 -2.5340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7740 -2.6610 -3.7780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5970 -3.1470 -4.7150 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2410 -3.2430 -4.1090 S 0 0 0 0 0 0 0 0 0 0 0 0 2.8010 -2.6170 -2.5860 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6850 -2.4070 -1.5400 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9910 -2.7010 -1.6910 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3940 -3.1500 -2.7430 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9520 -2.4720 -0.5520 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3010 -2.8680 -0.9650 N 0 0 0 0 0 0 0 0 0 0 0 0 8.3680 -2.7460 -0.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6480 -3.1200 -0.4610 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7010 -2.9980 0.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4820 -2.5040 1.6970 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2090 -2.1310 2.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1530 -2.2450 1.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6330 -2.3730 2.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6790 -2.4610 -3.9870 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1370 -1.7760 -5.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4920 -1.5930 -5.3020 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3950 -2.0870 -4.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9470 -2.7660 -3.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5950 -2.9610 -3.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8730 -1.8820 -4.5900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2910 -3.4400 -5.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3630 -2.0480 -0.6980 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9490 -1.4170 -0.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6450 -3.0690 0.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4530 -3.2140 -1.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8190 -3.5070 -1.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6960 -3.2900 0.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0420 -1.7460 3.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1600 -1.9490 1.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0870 -1.3880 2.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2690 -2.4960 3.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3770 -3.1410 2.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4330 -1.3900 -5.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8470 -1.0640 -6.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6560 -3.1490 -2.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2460 -3.4950 -2.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2770 -2.7190 -5.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3740 -1.8260 -3.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0360 -0.9550 -5.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 10 2 0 0 0 0 7 8 2 0 0 0 0 7 23 1 0 0 0 0 8 9 1 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 40 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 21 43 1 0 0 0 0 22 44 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 47 1 0 0 0 0 25 26 1 0 0 0 0 25 48 1 0 0 0 0 26 27 2 0 0 0 0 26 29 1 0 0 0 0 27 28 1 0 0 0 0 27 49 1 0 0 0 0 28 50 1 0 0 0 0 29 51 1 0 0 0 0 29 52 1 0 0 0 0 29 53 1 0 0 0 0 M END